1-Octen-4-yne structure

1-Octen-4-yne

oct-1-en-4-yne

Also Known As: 1-Octen-4-yne|oct-1-en-4-yne|Chlorouvedalin|Dipentylsuccinate|1-Octene-4-yne|1H-Benzotriazole,sulfate (1:1)|NP5596|J1.059.623H

CAS: 24694-80-2
Molecular Formula C8H12
Molecular Weight 108.0939 g/mol
LogP 3.1
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
Rotatable Bonds 2
Exact Mass 108.0939
Monoisotopic Mass 108.0939
Heavy Atoms 8
Complexity 108.0

Chemical Identifiers

CAS Number 24694-80-2
SMILES CCCC#CCC=C
InChIKey ICBXOVYWGIDVQO-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.

Agrochemicals (3 patents) Heterocyclic Building Blocks (14 patents) Organic Building Blocks (12 patents) Pharmaceutical Intermediates (28 patents)

Product Overview

1-Octen-4-yne (CAS 24694-80-2), with molecular formula C8H12 and molecular weight 108.0939 g/mol. IUPAC: oct-1-en-4-yne.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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